Home Carboxys 5-[(Anilinocarbonyl)amino]-2-thiophenecarboxylic acid

5-[(Anilinocarbonyl)amino]-2-thiophenecarboxylic acid

CAS No.:
924862-06-6
Catalog Number:
AG00JAO8
Molecular Formula:
C12H10N2O3S
Molecular Weight:
262.2844
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Product Description
Catalog Number:
AG00JAO8
Chemical Name:
5-[(Anilinocarbonyl)amino]-2-thiophenecarboxylic acid
CAS Number:
924862-06-6
Molecular Formula:
C12H10N2O3S
Molecular Weight:
262.2844
MDL Number:
MFCD09028369
IUPAC Name:
5-(phenylcarbamoylamino)thiophene-2-carboxylic acid
InChI:
InChI=1S/C12H10N2O3S/c15-11(16)9-6-7-10(18-9)14-12(17)13-8-4-2-1-3-5-8/h1-7H,(H,15,16)(H2,13,14,17)
InChI Key:
JLLLHLGDJUCBMB-UHFFFAOYSA-N
SMILES:
O=C(Nc1ccc(s1)C(=O)O)Nc1ccccc1
Properties
Complexity:
318  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.041g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
262.283g/mol
Monoisotopic Mass:
262.041g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
107A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties